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(3S,5S) and (3R,5R)-5-Acetoxy-1-ethynyl-3-hydroxycyclohex-1-ene
SpectraBase Compound ID CTlWYUF9qD2
InChI InChI=1S/C10H12O3/c1-3-8-4-9(12)6-10(5-8)13-7(2)11/h1,4,9-10,12H,5-6H2,2H3/t9-,10+/m1/s1
InChIKey OJJMTHFTFNNVJT-ZJUUUORDSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5Ba2aWiDK3
Name (3S,5S) and (3R,5R)-5-Acetoxy-1-ethynyl-3-hydroxycyclohex-1-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-3-8-4-9(12)6-10(5-8)13-7(2)11/h1,4,9-10,12H,5-6H2,2H3/t9-,10+/m1/s1
InChIKey OJJMTHFTFNNVJT-ZJUUUORDSA-N
Molecular Weight 180.203 g/mol
SMILES O[C@@]1(C=C(C#C)C[C@](OC(=O)C)(C1)[H])[H]
SPLASH splash10-006x-9700000000-1602adacf7a13e8ba99e
Source of Spectrum KD-13-545-19
Wiley ID 1635011